ethanedioic acid; N-[3-(2-propan-2-yloxyphenoxy)propyl]butan-2-amine

Systemtic Name: ethanedioic acid; N-[3-(2-propan-2-yloxyphenoxy)propyl]butan-2-amine Openeye Name: N-[3-(2-isopropoxyphenoxy)propyl]butan-2-amine; oxalic acid CAS Name: oxalic acid; N-[3-(2-propan-2-yloxyphenoxy)propyl]-2-butanamine IUPAC Name: oxalic acid; N-[3-(2-propan-2-yloxyphenoxy)propyl]butan-2-amine Traditional Name: 3-(2-isopropoxyphenoxy)propyl-sec-butyl-amine; oxalic acid Formula: C18H29NO6 MolecularWeight: 355.42596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCCOC1=CC=CC=C1OC(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)NCCCOC1=CC=CC=C1OC(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H27NO2.C2H2O4/c1-5-14(4)17-11-8-12-18-15-9-6-7-10-16(15)19-13(2)3;3-1(4)2(5)6/h6-7,9-10,13-14,17H,5,8,11-12H2,1-4H3;(H,3,4)(H,5,6)